In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 29 | No |
Popular Name: (2S)-3-(4-allyloxy-3-methyl-benzoyl)-4-hydroxy-2-(2-nitrophenyl)-1,2-dihydropyrrol-5-one (2S)-3-(4-allyloxy-3-methyl-benz…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.12 | 6.77 | -53.46 | 1 | 8 | -1 | 124 | 393.375 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 6.01 | -11.36 | 2 | 8 | 0 | 121 | 394.383 | 7 | ↓ |